tert-butyl 4-[[3-(4-chloranyl-1,3-thiazol-2-yl)phenyl]carbamoyloxymethyl]piperidine-1-carboxylate

Systemtic Name: tert-butyl 4-[[3-(4-chloranyl-1,3-thiazol-2-yl)phenyl]carbamoyloxymethyl]piperidine-1-carboxylate Openeye Name: tert-butyl 4-[[3-(4-chlorothiazol-2-yl)phenyl]carbamoyloxymethyl]piperidine-1-carboxylate CAS Name: 4-[[[3-(4-chloro-2-thiazolyl)anilino]-oxomethoxy]methyl]-1-piperidinecarboxylic acid tert-butyl ester IUPAC Name: tert-butyl 4-[[3-(4-chloro-1,3-thiazol-2-yl)phenyl]carbamoyloxymethyl]piperidine-1-carboxylate Traditional Name: 4-[[3-(4-chlorothiazol-2-yl)phenyl]carbamoyloxymethyl]piperidine-1-carboxylic acid tert-butyl ester Formula: C21H26ClN3O4S MolecularWeight: 451.96684

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)OC(=O)N1CCC(CC1)COC(=O)NC2=CC=CC(=C2)C3=NC(=CS3)Cl

Isomeric SMILES

CC(C)(C)OC(=O)N1CCC(CC1)COC(=O)NC2=CC=CC(=C2)C3=NC(=CS3)Cl

InChI

InChI=1S/C21H26ClN3O4S/c1-21(2,3)29-20(27)25-9-7-14(8-10-25)12-28-19(26)23-16-6-4-5-15(11-16)18-24-17(22)13-30-18/h4-6,11,13-14H,7-10,12H2,1-3H3,(H,23,26)